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MCULE-5787306636-3
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 20 USD | 98 | 11 working days | Get Quote |
| 5 mg | 20 USD | 98 | 11 working days | Get Quote |
| 10 mg | 20 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5787306636-3.sdf |
| SMILES | MCULE-5787306636-3.smiles |
| Standard InChI | MCULE-5787306636-3.inchi |
| InChIKey | MCULE-5787306636-3.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869190618 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505354262 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505389103 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-869264164 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-864176339 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868580111 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-608494029 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-580433415 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862056857 | FluoroChem | General BB | 95 | As is | in stock |
| P-474027333 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-500374058 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-502372480 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 167.195 |
| logP | 1.1789 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 0 |
| PSA | 115.47 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 43.4778 |
| Atoms | 16 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 5 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
